Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Lithium Ion. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 20/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 16/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9577755 | 0.86 | OPRD1 (0.59) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| Lithium Ion SCHEMBL7399286 | 0.85 | OPRD1 (0.49) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL1237576 | 0.83 | OPRD1 (0.80) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| Lithium Ion SCHEMBL4283263 | 0.76 | OPRD1 (0.56) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL9845357 | 0.73 | OPRD1 (0.45) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL1237845 | 0.73 | OPRD1 (0.45) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL3696965 | 0.72 | OPRD1 (0.54) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL19289109 | 0.71 | OPRD1 (0.66) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| SCHEMBL467151 | 0.71 | OPRD1 (1.00) | OPRD1KCNH2OPRK1CYP2D6OPRM1 | |
| Hydrochloric Acid SCHEMBL12481185 | 0.70 | OPRD1 (0.97) | OPRD1KCNH2OPRK1CYP2D6OPRM1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1232160-A1 | SPIRO(2H-1-BENZOPYRAN-2,4'-PIPERIDINE)DERIVATES AS GLYCINE TRANSPORT INHIBITORS | Akzo Nobel N.V. (NL) | 2002-08-21 | — | — | EP | disclosed |
| WO-2001036423-A1 | SPIRO(2H-1-BENZOPYRAN-2,4'-PIPERIDINE) DERIVATES AS GLYCINE TRANSPORT INHIBITORS | AKZO NOBEL N.V. (NL) | 2001-05-25 | — | — | WO | disclosed |